CID 12112232

3-(piperidin-4-yloxy)pyridine dihydrochloride

Structural Information

Molecular Formula

C₁₀H₁₄N₂O

SMILES

C1CNCCC1OC2=CN=CC=C2

InChI

InChI=1S/C10H14N2O/c1-2-10(8-12-5-1)13-9-3-6-11-7-4-9/h1-2,5,8-9,11H,3-4,6-7H2

InChIKey

URPWHVAXGCXZOR-UHFFFAOYSA-N

Compound name

3-piperidin-4-yloxypyridine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 123
Patents: 178.11061 Da
Monoisotopic Mass: 0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	179.117886	139.1
[M+Na]+	201.099828	143.8
[M-H]-	177.103334	140.5
[M+NH4]+	196.144433	155.0
[M+K]+	217.073768	140.8
[M+H-H2O]+	161.107870	130.6
[M+HCOO]-	223.108811	156.5
[M+CH3COO]-	237.124461	150.0
[M+Na-2H]-	199.085276	145.9
[M]+	178.11006142	133.0
[M]-	178.11115858	133.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe